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Home > Indoles and Oxindole > 710945-70-3
710945-70-3 | N-(1H-indol-5-yl)-3,5-dimethyl-4-isoxazolesulfonamide
CAS No: 710945-70-3 Catalog No: AG01CAQQ MDL No:MFCD03086532
Product Description
Catalog Number:
AG01CAQQ
Chemical Name:
N-(1H-indol-5-yl)-3,5-dimethyl-4-isoxazolesulfonamide
CAS Number:
710945-70-3
Molecular Formula:
C13H13N3O3S
Molecular Weight:
291.3256
MDL Number:
MFCD03086532
IUPAC Name:
N-(1H-indol-5-yl)-3,5-dimethyl-1,2-oxazole-4-sulfonamide
InChI:
InChI=1S/C13H13N3O3S/c1-8-13(9(2)19-15-8)20(17,18)16-11-3-4-12-10(7-11)5-6-14-12/h3-7,14,16H,1-2H3
InChI Key:
IVYRUNDEZKXYTG-UHFFFAOYSA-N
SMILES:
Cc1onc(c1S(=O)(=O)Nc1ccc2c(c1)cc[nH]2)C
Properties
Complexity:
450
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
291.068g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
291.325g/mol
Monoisotopic Mass:
291.068g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
96.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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